81 citations · 98 across the 5 of their papers we have counts for
5 papers
Analyzing cases of significant nondynamic correlation with DFT using the Atomic Populations of Effectively Localized Electrons
Conrad Lewis, Emil Proynov, Jianguo Yu +1
Multireference effects are associated with degeneracies and near-degeneracies of the ground state and are critical to a variety of systems. Most approximate functionals of density…
Reducing charge delocalization error of density functional theory
Emil Proynov, Jing Kong
The charge delocalization error, besides nondynamic correlation, has been a major challenge to density functional theory. Contemporary functionals undershoot the dissociation of sy…
Density Functional Model for Nondynamic and Strong Correlation
Jing Kong, Emil Proynov
A single-term density functional model for nondynamic and strong correlation is presented, based on single-determinant Kohn-Sham density functional theory. It is derived from model…
Accurate calculation of the bound states of Hellmann potential
Amlan K. Roy
Bound states of the Hellmann potential, which is a superposition of the attractive Coulomb () and the Yukawa () potential, are calculated by using a generalized p…
Bound state spectra of the 3D rational potential
Amlan K. Roy, Abraham F. Jalbout, Emil I. Proynov
We present bound state spectra of the 3D rational potential, , , by means of the generalized pseudospectral method. All the thirty states correspondi…